LDV
Summary
| Name: | 3-[(4-methylpiperidin-1-yl)methyl]-1H-indole |
| Formula: | C15 H20 N2 |
| Formal charge: | 0 |
| Formula weight: | 228.333 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-[(4-methylpiperidin-1-yl)methyl]-1H-indole |
| OpenEye OEToolkits | 2.0.6 | 3-[(4-methylpiperidin-1-yl)methyl]-1~{H}-indole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N1(CCC(CC1)C)Cc3c2c(cccc2)nc3 |
| InChI | InChI | 1.03 | InChI=1S/C15H20N2/c1-12-6-8-17(9-7-12)11-13-10-16-15-5-3-2-4-14(13)15/h2-5,10,12,16H,6-9,11H2,1H3 |
| InChIKey | InChI | 1.03 | DGCGMYNLCDVYMB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC1CCN(CC1)Cc2c[nH]c3ccccc23 |
| SMILES | CACTVS | 3.385 | CC1CCN(CC1)Cc2c[nH]c3ccccc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC1CCN(CC1)Cc2c[nH]c3c2cccc3 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CC1CCN(CC1)Cc2c[nH]c3c2cccc3 |
